4,6-Dichloro-7-azaindole supplier

Name
1H-Pyrrolo[2,3-b]pyridine, 4,6-dichloro-
EINECS 1312995-182-4
CAS No. 5912-18-5
Article Data1
CAS DataBase
Density 1.571 g/cm³
Solubility
Melting Point 207-208 °C
Formula C₇H₄Cl₂N₂
Boiling Point 319.4 °C at 760 mmHg
Molecular Weight 187.028
Flash Point 176.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4,6-Dichloro-7-azaindole;
PSA 28.68000
LogP 2.86970

4,6-Dichloro-7-azaindole Specification

The CAS register number of 4,6-Dichloro-7-azaindole is 5912-18-5. It also can be called as 1H-Pyrrolo[2,3-b]pyridine, 4,6-dichloro- and the systematic name about this chemical is 4,6-dichloro-1H-pyrrolo[2,3-b]pyridine.

Physical properties about 4,6-Dichloro-7-azaindole are: (1)ACD/LogP: 3.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.15; (4)ACD/LogD (pH 7.4): 3.15; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 28.68Å²; (9)Index of Refraction: 1.708; (10)Molar Refractivity: 46.4 cm³; (11)Molar Volume: 118.9 cm³; (12)Surface Tension: 64 dyne/cm; (13)Density: 1.571 g/cm³; (14)Flash Point: 176.4 °C; (15)Enthalpy of Vaporization: 53.86 kJ/mol; (16)Boiling Point: 319.4 °C at 760 mmHg; (17)Vapour Pressure: 0.000635 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: c1c[nH]c2c1c(cc(n2)Cl)Cl
2.InChI: InChI=1/C7H4Cl2N2/c8-5-3-6(9)11-7-4(5)1-2-10-7/h1-3H,(H,10,11)
3.InChIKey: LKORXMRYXIGVNO-UHFFFAOYAW
4.Std. InChI: InChI=1S/C7H4Cl2N2/c8-5-3-6(9)11-7-4(5)1-2-10-7/h1-3H,(H,10,11)

Product Name

1H-Pyrrolo[2,3-b]pyridine, 4,6-dichloro-

4,6-Dichloro-7-azaindole Specification

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